SCHEMBL26857079

SCHEMBL26857079

COCc1n[nH]cc1C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CACNA1H O95180 2/20 0.39
TRPA1 O75762 1/20 0.33
PDE2A O00408 1/20 0.32
RAB9A P51151 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL12221495 0.82 HCAR2 (0.33)
SCHEMBL26854524 0.80
SCHEMBL20904063 0.74
SCHEMBL20734526 0.72 HSD11B1 (0.34)
SCHEMBL15186249 0.71
SCHEMBL15555947 0.71
SCHEMBL15372134 0.69
SCHEMBL21031169 0.69 TRPA1 (0.36) CACNA1HTRPA1
SCHEMBL2198261 0.69 HSD11B1 (0.31)
SCHEMBL27680703 0.68

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023230190-A1 PYRIMIDINE BASED MODULATORS AND USES THEREOF QUANTA THERAPEUTICS, INC. (US) 2023-11-30 WO disclosed